For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[[[3,5,6,7-tetrahydro-4-oxo-3-(2-propenyl)-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[[[3,5,6,7-tetrahydro-4-oxo-3-(2-propenyl)-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, ethyl ester
SpectraBase Compound ID AJHH1YwwlY6
InChI InChI=1S/C26H29N3O4S3/c1-3-13-29-24(31)20-15-10-8-12-18(15)35-22(20)28-26(29)34-14-19(30)27-23-21(25(32)33-4-2)16-9-6-5-7-11-17(16)36-23/h3H,1,4-14H2,2H3,(H,27,30)
InChIKey ZPEHTWCXFYZCBP-UHFFFAOYSA-N
Mol Weight 543.72 g/mol
Molecular Formula C26H29N3O4S3
Exact Mass 543.13202 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Cy279c72ZUX
Name 4H-cyclohepta[b]thiophene-3-carboxylic acid, 5,6,7,8-tetrahydro-2-[[[[3,5,6,7-tetrahydro-4-oxo-3-(2-propenyl)-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, ethyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H29N3O4S3/c1-3-13-29-24(31)20-15-10-8-12-18(15)35-22(20)28-26(29)34-14-19(30)27-23-21(25(32)33-4-2)16-9-6-5-7-11-17(16)36-23/h3H,1,4-14H2,2H3,(H,27,30)
InChIKey ZPEHTWCXFYZCBP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_390
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11228010